5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile

C13H16N4O2 — CID 97120466

IUPAC5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile
SMILESC[C@@H](Nc1ccc(C#N)nc1)C(=O)N1CCOCC1
InChIInChI=1S/C13H16N4O2/c1-10(13(18)17-4-6-19-7-5-17)16-12-3-2-11(8-14)15-9-12/h2-3,9-10,16H,4-7H2,1H3/t10-/m1/s1
InChIKeyQLSVIYIDSUALBN-SNVBAGLBSA-N
MW260.30 g/mol
LogP0.61
Rot. Bonds3

About 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile

5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile (PubChem CID 97120466) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile
PubChem CID97120466
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile
SMILESC[C@@H](Nc1ccc(C#N)nc1)C(=O)N1CCOCC1
InChIInChI=1S/C13H16N4O2/c1-10(13(18)17-4-6-19-7-5-17)16-12-3-2-11(8-14)15-9-12/h2-3,9-10,16H,4-7H2,1H3/t10-/m1/s1
InChIKeyQLSVIYIDSUALBN-SNVBAGLBSA-N
XLogP0.61
TPSA78.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile with MolForge

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Related Compounds

(2R)-1-morpholin-4-yl-2-[(6-propan-2-yloxy-3-pyridinyl)amino]propan-1-one
CID 95579028
2-[4-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]phenoxy]benzonitrile
CID 52507271
2-[4-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]phenyl]acetonitrile
CID 60661902
5-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-(trifluoromethyl)benzonitrile
CID 75520261
1-morpholin-4-yl-2-[4-(trifluoromethyl)anilino]propan-1-one
CID 43084708
N-[4-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]phenyl]methanesulfonamide
CID 31268214
6-[(3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl)amino]pyridazine-3-carbonitrile
CID 133420091
2-fluoro-6-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]benzonitrile
CID 43580691
2-methyl-6-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]pyridine-4-carbonitrile
CID 114766592
2-(3,5-dichloro-4-fluoroanilino)-1-morpholin-4-ylpropan-1-one
CID 103579849
2-(3-chloro-4-fluoroanilino)-1-morpholin-4-ylpropan-1-one
CID 78907264
2-[3-(dimethylamino)-4-methylanilino]-1-morpholin-4-ylpropan-1-one
CID 115378152

Frequently Asked Questions

What is the IUPAC name of 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile?
The IUPAC name of 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile (CID 97120466) is 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile.
What is the SMILES notation for 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile?
The canonical SMILES for 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile is C[C@@H](Nc1ccc(C#N)nc1)C(=O)N1CCOCC1.
What is the InChIKey of 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile?
The InChIKey is QLSVIYIDSUALBN-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-10(13(18)17-4-6-19-7-5-17)16-12-3-2-11(8-14)15-9-12/h2-3,9-10,16H,4-7H2,1H3/t10-/m1/s1.
What are the key properties of 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile?
5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile has a molecular weight of 260.30 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]amino]pyridine-2-carbonitrile is sourced from PubChem (CID 97120466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).